Thanks so much. That should work for me, for now at least.
Looking to the future, a more general ability to start from a previous calculation might be nice e.g. for testing different approaches to seeding the SCF routine. But since it’s open sources I guess I should put up or shut up
The Python iterations are now fully in Python so it is quite easy to alter that code. Ping us on Slack or here for help and hooks on how to integrate this!
We should be close to allowing users to pass in wavefunctions for SCF as we have straightened out that code quiet a bit!